Anharmonicity in One-Dimensional Electron–Phonon System

Abstract

We investigate the effect of anharmonicity on the one-dimensional half-filled Holstein model by using the determinant quantum Monte Carlo method. By calculating the order parameters we find that with and without anharmonicity there is always an transition from a disorder phase to a dimerized phase. Moreover, in the dimerized phase a lattice dimerization and a charge density wave coexist. The anharmonicity represented by the quartic term suppresses the dimerization as well as the charge density wave, while a double-well potential favors the dimerization. In addition, by calculating the correlation exponents we show that the disorder phase is metallic with gapless charge excitations and gapful spin excitations while in the dimerized phase both excitations are gapful.